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8-isopropyl-4,5-dihydro-1-benzoxepin-3-one
SpectraBase Compound ID B6sNOj477A5
InChI InChI=1S/C13H16O2/c1-9(2)11-4-3-10-5-6-12(14)8-15-13(10)7-11/h3-4,7,9H,5-6,8H2,1-2H3
InChIKey GZGDHHGMHKNKBQ-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9FvK4hbAmif
Name 8-isopropyl-4,5-dihydro-1-benzoxepin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-9(2)11-4-3-10-5-6-12(14)8-15-13(10)7-11/h3-4,7,9H,5-6,8H2,1-2H3
InChIKey GZGDHHGMHKNKBQ-UHFFFAOYSA-N
Molecular Weight 204.269 g/mol
SMILES C1Oc2c(CCC1=O)ccc(c2)C(C)C
SPLASH splash10-0uds-1920000000-b8d79bd5246bc4a68f09
Source of Spectrum H-90-1262-10
Synonyms 8-Propan-2-yl-4,5-dihydro-1-benzoxepin-3-one
Wiley ID 1590799